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Ab initio molecular dynamics and materials design for embedded phase-change memory2021 npj Computational Materials article Materials Science Phase-change materials and chalcogenides Open access
Liang Sun, Yuxing Zhou, Xudong Wang, Yuhan Chen, Volker L. Deringer, Riccardo Mazzarello, +1 more
70citations -
Materials Design by Constructing Phase Diagrams for Defects2024 Advanced Materials article Materials Science Magnesium Alloys: Properties and Applications Open access
Xuyang Zhou, Prince Mathews, Benjamin Berkels, Wassilios J. Delis, Amel Shamseldeen Ali Alhassan, Philipp Keuter, +8 more
24citations -
Opportunities of combinatorial thin film materials design for the sustainable development of magnesium-based alloys2021 Scientific Reports article Materials Science Magnesium Alloys: Properties and Applications Open access
Marcus Hans, Philipp Keuter, Aparna Saksena, Janis A. Sälker, Markus Momma, Hauke Springer, +4 more
16citations -
Towards the design of artificial sensing materials via quantum-informed explainable AI2026 Journal of Cheminformatics article Materials Science Machine Learning in Materials Science Open access
Li Chen, Leonardo Rafael Medrano Sandonas, Shirong Huang, Alexander Croy, Gianaurelio Cuniberti
2citations -
An innovative approach to design SOFC air electrode materials: high entropy La 1−x Sr x (Co,Cr,Fe,Mn,Ni)O 3−δ ( x = 0, 0.1, 0.2, 0.3) perovskites synthesized by the sol–gel method2020 Journal of Materials Chemistry A article Materials Science Advancements in Solid Oxide Fuel Cells
Juliusz Dąbrowa, Andreas Falkenstein, Christian Günter Georg Schwab, Maria Szymczak, Marek Zajusz, Maciej Moździerz, +6 more
200citations -
Modular design of biomimetic electrospun keratin composites for tunable gaseous sorption inspired by reptile eggshells2025 Materials Today Bio article Materials Science Electrospun Nanofibers in Biomedical Applications Open access
Yana Maudens, Gerben Debruyn, Eva Loccufier, Lode Daelemans, Erica Savino, Cinzia Tonetti, +5 more
2citations -
Supporting Safe-by-Design of Multicomponent Nanomaterials by Linking Functionality-Related Properties with Potential Safety Issues2025 Sustainability & Circularity NOW article Materials Science Nanoparticles: synthesis and applications Open access
Elmer Swart, Jan Harm Westerdiep, Elena Badetti, Andrea Brunelli, Virginia Cazzagon, Teresa F. Fernandes, +10 more
2citations -
Roadmap for phase change materials in photonics and beyond2023 iScience article Materials Science Phase-change materials and chalcogenides Open access cited by 1 patent
Patinharekandy Prabhathan, Kandammathe Valiyaveedu Sreekanth, Jinghua Teng, Joo Hwan Ko, Young Jin Yoo, Hyeon‐Ho Jeong, +33 more
128citations -
Revisiting the Nature of Chemical Bonding in Chalcogenides to Explain and Design their Properties2022 Advanced Materials article Materials Science Phase-change materials and chalcogenides Open access cited by 1 patent
Matthias Wuttig, Carl‐Friedrich Schön, Jakob Lötfering, Pavlo Golub, Carlo Gatti, Jean‐Yves Raty
161citations -
The potential of chemical bonding to design crystallization and vitrification kinetics2021 Nature Communications article Materials Science Phase-change materials and chalcogenides Open access
Christoph Persch, Maximilian J. Müller, Aakash Yadav, Julian Pries, Natalie Honné, Peter Kerres, +6 more
57citations